4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt
TL;DR: 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt (CAS 32980-06-6) is a chemical compound with molecular formula C12H18N2O4 and molecular weight 254.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azanium 3,5-diacetyl-2,6-dimethyl-1,4-dihydropyridine-4-carboxylate
Also Known As: 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt, ammonium 3,5-diacetyl-2,6-dimethyl-1,4-dihydropyridine-4-carboxylate, Azanium,3,5-diacetyl-2,6-dimethyl-1,4-dihydropyridine-4-carboxylate, azanium 3,5-diacetyl-2,6-dimethyl-1,4-dihydropyridine-4-carboxylate, 4-PYRIDINECARBOXYLIC ACID, 3,5-DIACETYL-1,4-DIHYDRO-2,6-DIMETHYL-,
| Molecular Formula | C12H18N2O4 |
|---|---|
| Molecular Weight | 254.13 g/mol |
| LogP | 0.0579 |
| Topological Polar Surface Area | 87.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.12666 |
| Heavy Atoms | 18 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 32980-06-6 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)C)C(=O)[O-])C(=O)C.[NH4+] |
| InChIKey | PVOWIXZJMMOEKY-UHFFFAOYSA-N |
Product Overview
4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt (CAS 32980-06-6), with molecular formula C12H18N2O4 and molecular weight 254.13 g/mol. IUPAC: azanium 3,5-diacetyl-2,6-dimethyl-1,4-dihydropyridine-4-carboxylate.
Chemical Property Profile of 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt
Property Insights of 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt
The XLogP value of 0.0579 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt. Following Lipinski's Rule of Five, 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt?
The CAS number of 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt is 32980-06-6.
What is the molecular formula of 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt?
The molecular formula of 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt is C12H18N2O4.
What is the molecular weight of 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt?
The molecular weight of 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt is 254.13 g/mol.
Where can I buy 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt?
You can request a quote for 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyridinecarboxylic acid, 3,5-diacetyl-1,4-dihydro-2,6-dimethyl-, monoammonium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.